N'-[1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[1-(4-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carbonyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[[1-[4-(methylthio)phenyl]-5-oxo-3-pyrrolidinyl]-oxomethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[1-(4-methylsulfanylphenyl)-5-oxopyrrolidine-3-carbonyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-[5-keto-1-[4-(methylthio)phenyl]pyrrolidine-3-carbonyl]-3H-phthalazine-1-carbohydrazide Formula: C21H19N5O4S MolecularWeight: 437.47166

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CSC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H19N5O4S/c1-31-14-8-6-13(7-9-14)26-11-12(10-17(26)27)19(28)23-25-21(30)18-15-4-2-3-5-16(15)20(29)24-22-18/h2-9,12H,10-11H2,1H3,(H,23,28)(H,24,29)(H,25,30)